Workshop Presentations
Large Scale Computing and Storage Requirements for Basic Energy Sciences
An BES / ASCR / NERSC Workshop
February 9-10, 2010
BES/NERSC Requirements Gathering Workshop, Workshop Goals
February 9, 2010
Author(s): Yukiko Sekine
Workshop outline, logistics, format, procedures
February 9, 2010
Author(s): Richard Gerber
BES Program Office Research Directions
February 9, 2010
Author(s): Mark Pederson
NERSC Role in Basic Energy Sciences Research
February 9, 2010
Author(s): Kathy Yelick
Case Studies: Geosciences DOE POC: Nicholas Woodward
February 9, 2010
Author(s): Andrew Felmy
3D Geophysical Modeling and Imaging
February 9, 2010
Author(s): Greg Newman
High-Performance computing for reactive flow and transport
February 9, 2010
Author(s): Tony Ladd, Piotr Szymczak
Simulation based on DFT
February 9, 2010
Author(s): Hai-Ping Cheng
Defect Physics of Structural Materials for Energy Ab initio methods for simulating the structure, interactions and dynamics of defects in structural materials for extreme environments
February 9, 2010
Author(s): G. Malcolm Stocks, Don M. Nicholson, Markus Eisenbach, Paul Kent, Aurelian Rusanu, Fernando Reboredo, Randy Hood, Jeongnim Kim
A DFT nanostructure calculation case study
February 9, 2010
Author(s): Lin-Wang Wang
Quantum Monte Carlo Calculations of Solids
February 9, 2010
Author(s): Burkhard Militzer
Simulations of correlated electrons: What's under the superconducting dome in the two-dimensional Hubbard model?
February 9, 2010
Author(s): Mark Jarrell
Quantum Monte Carlo for the Electronic Structure of Atoms and Molecules
February 9, 2010
Author(s): Brian Austin
Spectroscopy and Light-Matter Interactions
February 9, 2010
Author(s): T. P. Devereaux
Theory & Simulation of Light‐Matter Interactions (& Charge Transport) at Nanoscale Interfaces
February 9, 2010
Author(s): Jeff Neaton
Classical Molecular Dynamics Codes and Coupling of Length Scales
February 9, 2010
Author(s): Peter T. Cummings, Normand Modine and Randy Cygan
The Nature of the Mineral-Water Interface: A Molecular Simulation and Spectroscopic Investigation
February 9, 2010
Author(s): Randall T. Cygan